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Murcko scaffold

Isoquinoline, 2-benzoyl-1,2-dihydro- scaffold

18 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
18
With full pages
3
Scaffold SMILES

O=C(c1ccccc1)N1C=Cc2ccccc2C1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffoldOpen the Isoquinoline, 2-benzoyl-1,2-dihydro- page
Murcko scaffold O=C(c1ccccc1)N1C=Cc2ccccc2C1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 18 of 18 chemicals

2-Benzoyl-1,2-dihydro-1-isoquinolinecarbonitrile chemical structure, C17H12N2O, CAS 844-25-7
2-Benzoyl-1,2-dihydro-1-isoquinolinecarbonitrile
CAS 844-25-7C17H12N2O
Methyl 2-benzoyl-1-cyano-1,2-dihydroisoquinoline-1-carbodithioate chemical structure, C19H14N2OS2, CAS 6457-28-9
Methyl 2-benzoyl-1-cyano-1,2-dihydroisoquinoline-1-carbodithioate
CAS 6457-28-9C19H14N2OS2
2-Benzoyl-3-methyl-1,2-dihydroisoquinoline-1-carbonitrile chemical structure, C18H14N2O, CAS 21259-77-8
2-Benzoyl-3-methyl-1,2-dihydroisoquinoline-1-carbonitrile
CAS 21259-77-8C18H14N2O
2-Benzoyl-1-methylisoquinoline-1-carbonitrile chemical structure, C18H14N2O, CAS 16576-32-2
2-Benzoyl-1-methylisoquinoline-1-carbonitrile
CAS 16576-32-2C18H14N2O
2-(4-Chlorobenzoyl)-1,2-dihydroisoquinoline-1-carbonitrile chemical structure, C17H11ClN2O, CAS 58021-74-2
2-(4-Chlorobenzoyl)-1,2-dihydroisoquinoline-1-carbonitrile
CAS 58021-74-2C17H11ClN2O
2-(3-Chlorobenzoyl)-1,2-dihydroisoquinoline-1-carbonitrile chemical structure, C17H11ClN2O, CAS 94540-21-3
2-(3-Chlorobenzoyl)-1,2-dihydroisoquinoline-1-carbonitrile
CAS 94540-21-3C17H11ClN2O
RefChem:357252 chemical structure, C18H14N2O2, CAS 58021-73-1
RefChem:357252
CAS 58021-73-1C18H14N2O2
2-Benzoyl-1,2-dihydroisoquinoline-1-carboxamide chemical structure, C17H14N2O2, CAS 93323-61-6
2-Benzoyl-1,2-dihydroisoquinoline-1-carboxamide
CAS 93323-61-6C17H14N2O2
2-(2-Benzoyl-1-cyano-1,2-dihydroisoquinolin-1-yl)-n,n-diethylacetamide chemical structure, C23H23N3O2, CAS 32431-46-2
2-(2-Benzoyl-1-cyano-1,2-dihydroisoquinolin-1-yl)-n,n-diethylacetamide
CAS 32431-46-2C23H23N3O2
2-Benzoyl-6,7-dimethoxy-1,2-dihydroisoquinoline-1-carbonitrile chemical structure, C19H16N2O3, CAS 35096-40-3
2-Benzoyl-6,7-dimethoxy-1,2-dihydroisoquinoline-1-carbonitrile
CAS 35096-40-3C19H16N2O3
2-[(4-Nitrophenyl)carbonyl]-1,2-dihydroisoquinolinecarbonitrile chemical structure, C17H11N3O3, CAS 64319-89-7
2-[(4-Nitrophenyl)carbonyl]-1,2-dihydroisoquinolinecarbonitrile
CAS 64319-89-7C17H11N3O3
AQ-405/42300296 chemical structure, C19H16N2O, CAS 22480-80-4
AQ-405/42300296
CAS 22480-80-4C19H16N2O
Isoquinoline, 2-benzoyl-1,2-dihydro- chemical structure, C16H13NO, CAS 50624-29-8
Isoquinoline, 2-benzoyl-1,2-dihydro-
CAS 50624-29-8C16H13NO
2-Benzoyl-5-bromo-1-cyano-1,2-dihydroisoquinoline chemical structure, C17H11BrN2O, CAS 67335-09-5
2-Benzoyl-5-bromo-1-cyano-1,2-dihydroisoquinoline
CAS 67335-09-5C17H11BrN2O
(1-Hydroxy-5-nitroisoquinolin-2(1H)-yl)(4-methoxyphenyl)methanone chemical structure, C17H14N2O5, CAS 53599-70-5
(1-Hydroxy-5-nitroisoquinolin-2(1H)-yl)(4-methoxyphenyl)methanone
CAS 53599-70-5C17H14N2O5
2-Benzoyl-1-butyl-1,2-dihydro-1-isoquinolinecarbonitrile chemical structure, C21H20N2O, CAS 16576-34-4
2-Benzoyl-1-butyl-1,2-dihydro-1-isoquinolinecarbonitrile
CAS 16576-34-4C21H20N2O
(1-Methylisoquinolin-2(1H)-yl)(phenyl)methanone chemical structure, C17H15NO, CAS 61456-83-5
(1-Methylisoquinolin-2(1H)-yl)(phenyl)methanone
CAS 61456-83-5C17H15NO
Isoquinoline,2-benzoyl-1,2-dihydro-4-methyl- chemical structure, C17H15NO, CAS 143360-48-9
Isoquinoline,2-benzoyl-1,2-dihydro-4-methyl-
CAS 143360-48-9C17H15NO